[3-(quinazolin-4-ylamino)phenyl] 2-chloranylbenzoate

Systemtic Name: [3-(quinazolin-4-ylamino)phenyl] 2-chloranylbenzoate Openeye Name: [3-(quinazolin-4-ylamino)phenyl] 2-chlorobenzoate CAS Name: 2-chlorobenzoic acid [3-(4-quinazolinylamino)phenyl] ester IUPAC Name: [3-(quinazolin-4-ylamino)phenyl] 2-chlorobenzoate Traditional Name: 2-chlorobenzoic acid [3-(quinazolin-4-ylamino)phenyl] ester Formula: C21H14ClN3O2 MolecularWeight: 375.80776

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC=N2)NC3=CC(=CC=C3)OC(=O)C4=CC=CC=C4Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC=N2)NC3=CC(=CC=C3)OC(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C21H14ClN3O2/c22-18-10-3-1-8-16(18)21(26)27-15-7-5-6-14(12-15)25-20-17-9-2-4-11-19(17)23-13-24-20/h1-13H,(H,23,24,25)